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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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325622 126684210 1 N2O3C13H14 A2B3C13D14 -47.9 6.45 -9.8 -0.75 0
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325623 126684212 1 NO5C14H27 AB5C14D27 -262.91 3.34 -9.86 0.94 0
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325624 126684218 1 IO2C5H11 AB2C5D11 -74.17 0.66 -9.73 -2.69 0
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325625 126684224 1 N2O3C18H24 A2B3C18D24 -143.19 5.55 -8.97 -0.17 0
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325626 126684228 1 N2O3C13H22 A2B3C13D22 -178.93 2.59 -10.26 0.14 0
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325627 126684229 1 N3O3C30H31 A3B3C30D31 -38.63 6.61 -8.43 0.17 0
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325628 126684235 1 N5O16C49H93 A5B16C49D93 -797.55 4.41 -9.33 0.33 0
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325629 126684240 1 ISN4O9C34H59 ABC4D9E34F59 -468.91 5.66 -9.44 -1.44 0
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325630 126684254 1 N3O5C18H31 A3B5C18D31 -230.37 5.43 -8.77 -0.78 0
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325631 126684256 1 NO6C19H33 AB6C19D33 -314.84 6.67 -10.3 -0.58 0
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325632 126684261 1 OSN3C4H9 ABC3D4E9 -10.0 4.78 -8.7 -0.56 0
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325633 126684268 2 N4O9C36H39 A4B9C36D39 -614.27 11.15 -8.28 -1.04 0
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325634 126684279 1 ON4C25H32 AB4C25D32 67.79 4.94 -7.58 -0.3 0
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325635 126684284 1 OC12H24 AB12C24 -85.68 2.36 -9.23 1.4 0
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325636 126684285 1 NO4S4C31H53 AB4C4D31E53 -233.71 2.36 -8.6 -1.2 0
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325637 126684288 1 O6N8C29H40 A6B8C29D40 -210.2 8.12 -9.27 -1.68 0
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325638 126684289 2 FOC11H16 ABC11D16 -195.77 2.88 -8.51 -0.26 0
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325639 126684295 1 SO5N13C21H43 AB5C13D21E43 -196.83 7.02 -9.09 -0.21 0
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325640 126684297 1 SO2F3N4H33C37 AB2C3D4E33F37 -35.4 20.88 -8.16 -2.41 0
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325641 126684302 1 Br2O2C19H30 A2B2C19D30 -123.08 2.18 -9.59 -0.32 0
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325642 126684304 1 O3N7C21H29 A3B7C21D29 -20.54 2.76 -8.65 -0.3 0
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325643 126684306 1 O2N7C13H21 A2B7C13D21 8.51 5.06 -8.62 -0.85 0
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325644 126684307 1 SO4N7C21H29 AB4C7D21E29 -64.02 7.68 -8.8 -0.6 0
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325645 126684312 1 NO2C9H13 AB2C9D13 -71.16 1.62 -8.2 0.4 0
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325646 126684315 1 FNSH12C19 ABCD12E19 61.5 5.39 -9.26 -1.16 0
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325647 126684326 1 NSF2H7C15 ABC2D7E15 44.29 6.99 -9.48 -1.6 0
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325648 126684328 2 ClO2C11H18 AB2C11D18 -239.75 4.27 -9.24 -0.08 0
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325649 126684331 1 NSF2H11C21 ABC2D11E21 67.16 7.51 -9.37 -1.6 0
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325650 126684338 1 FN3O4H26C27 AB3C4D26E27 -134.71 10.99 -9.08 -0.86 0
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325651 126684340 1 NSF3H16C19 ABC3D16E19 -80.34 7.47 -9.43 -1.23 0
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325652 126684342 1 FNSH10C15 ABCD10E15 51.41 5.88 -9.39 -1.29 0
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325653 126684371 1 N4O8H68C77 A4B8C68D77 106.45 8.94 -7.56 -0.2 1
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325654 126684375 1 ION2C40H40 ABC2D40E40 86.39 2.54 0.0 0.0 0
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325655 126684376 1 NC24H41 AB24C41 20.89 2.23 -8.46 2.01 0
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325656 126684382 2 NO2C11H19 AB2C11D19 -195.14 5.12 -8.73 0.43 0
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325657 126684383 1 O5C13H26 A5B13C26 -260.01 2.89 -9.8 0.81 0
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325658 126684387 1 NO3C7H11 AB3C7D11 -57.7 2.85 -9.6 -0.96 0
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325659 126684388 1 O2N3C17H23 A2B3C17D23 -61.85 6.16 -9.32 -0.99 0
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325660 126684391 1 ClO2N10C36H49 AB2C10D36E49 -14.37 7.09 -8.58 -0.94 0
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325661 126684392 1 O3N4C17H24 A3B4C17D24 -118.2 8.25 -8.46 0.21 0
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325662 126684394 1 O5C22H44 A5B22C44 -305.26 1.41 -9.81 0.3 0
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325663 126684396 2 NC13H27 AB13C27 -112.85 1.9 -8.4 2.8 0
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325664 126684397 1 NO4C14H19 AB4C14D19 -172.11 3.15 -8.66 0.31 0
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325665 126684402 1 SF2O5C19H28 AB2C5D19E28 -325.66 2.85 -9.32 -1.15 0
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325666 126684409 1 O4C17H26 A4B17C26 -185.76 1.74 -9.69 0.04 0
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325667 126684410 1 ClO6N10C38H51 AB6C10D38E51 -196.71 11.23 -8.68 -0.99 0
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325668 126684411 1 ClO6N10C44H63 AB6C10D44E63 -224.71 8.81 -8.62 -0.98 0
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325669 126684412 1 NO3C13H27 AB3C13D27 -163.17 5.25 -9.35 0.41 0
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325670 126684416 1 SF2O7C17H30 AB2C7D17E30 -443.38 4.54 -10.53 -1.26 0
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325671 126684422 1 SO7C15H28 AB7C15D28 -357.04 3.9 -10.83 -0.5 0
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325672 126684424 1 O7C20H34 A7B20C34 -333.29 2.14 -10.0 -1.01 0
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325673 126684426 1 FSO4N5C20H22 ABC4D5E20F22 -128.5 6.09 -8.74 -1.17 0
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325674 126684427 1 NF3C16H24 AB3C16D24 -186.68 6.58 -8.73 -0.1 0
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325675 126684431 1 ClSO4N5C20H22 ABC4D5E20F22 -91.76 4.26 -8.72 -1.29 0
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325676 126684439 2 NC6H9 AB6C9 21.48 3.94 -8.63 0.34 0
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325677 126684441 1 SN5O5C21H25 AB5C5D21E25 -124.21 4.69 -8.14 -0.91 0
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325678 126684443 1 SC10H16 AB10C16 46.86 3.91 -6.99 0.7 0
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325679 126684447 1 ClON2C5H9 ABC2D5E9 -0.09 3.18 -9.64 -0.3 0
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325680 126684462 1 Br2N2O2C57H70 A2B2C2D57E70 12.53 1.23 -8.71 -1.71 0
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325681 126684470 2 NS2O3C34H50 AB2C3D34E50 -249.99 3.39 -8.24 -1.48 0
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325682 126684472 1 ISC3F3H6 ABC3D3E6 -164.09 4.14 -8.43 -1.28 0
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325683 126684479 1 N3C13H15 A3B13C15 38.53 4.63 -9.41 -0.39 0
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325684 126684480 2 NH10C11 AB10C11 65.79 2.53 -8.83 -0.59 0
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325685 126684482 1 N4O7C52H78 A4B7C52D78 -345.88 3.14 -9.24 -0.38 0
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325686 126684483 1 O4C25H42 A4B25C42 -185.96 4.17 -8.76 0.53 0
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325687 126684484 1 N3O7C55H83 A3B7C55D83 -371.95 5.32 -9.12 -0.5 0
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325688 126684498 1 ClFN2O3H18C20 ABC2D3E18F20 -118.67 7.55 -9.77 -0.77 0
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325689 126684504 1 N2O3C17H26 A2B3C17D26 -51.44 4.09 -9.68 0.17 0
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325690 126684507 1 ClFNO5C26H33 ABCD5E26F33 -292.02 2.83 -9.28 -0.52 0
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325691 126684514 1 FCl2N2O2C19H21 AB2C2D2E19F21 -122.93 4.05 -9.41 -0.71 0
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325692 126684516 1 FCl2N2O4C24H29 AB2C2D4E24F29 -242.43 4.15 -9.42 -0.81 0
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325693 126684520 1 ClFNO4C21H23 ABCD4E21F23 -202.58 3.27 -9.43 -0.6 0
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325694 126684531 1 ClFNSO7C32H37 ABCDE7F32G37 -340.53 7.12 -9.21 -0.76 0
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325695 126684535 1 ClFN2O5C20H20 ABC2D5E20F20 -233.88 7.02 -9.41 -0.48 0
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325696 126684544 1 ClFN2O2C23H30 ABC2D2E23F30 -123.7 2.08 -8.78 -0.57 0